Structure of PDB 5rjy Chain A Binding Site BS01

Receptor Information
>5rjy Chain A (length=119) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
YDIQAWKKQCEELLNLIFQCEDSEPFRQPVDLLEYPDYRDIIDTPMDFAT
VRETLEAGNYESPMELCKDVRLIFSNSKAYTPSKRSRIYSMSLRLSAFFE
EHISSVLSDYKSALRFHKR
Ligand information
Ligand IDUV7
InChIInChI=1S/C6H9N3O/c1-5(10)7-2-6-3-8-9-4-6/h3-4H,2H2,1H3,(H,7,10)(H,8,9)
InChIKeyVFAFDDVJGKOBTH-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385
OpenEye OEToolkits 2.0.7		CC(=O)NCc1c[nH]nc1
ACDLabs 12.01n1cc(cn1)CNC(C)=O
FormulaC6 H9 N3 O
NameN-[(1H-pyrazol-4-yl)methyl]acetamide
ChEMBL
DrugBank
ZINCZINC000037987327
PDB chain5rjy Chain A Residue 1501 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB5rjy PanDDA analysis group deposition of ground-state model
Resolution1.25 Å
Binding residue
(original residue number in PDB)		P1340 Y1350 S1392 Y1395 I1403
Binding residue
(residue number reindexed from 1)		P25 Y35 S77 Y80 I88
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:5rjy, PDBe:5rjy, PDBj:5rjy
PDBsum5rjy
PubMed
UniProtQ8WWQ0|PHIP_HUMAN PH-interacting protein (Gene Name=PHIP)

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